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3,5-Dimethyl-1-hexyn-3-ol

View entire compound with spectra: 6 NMR, 10 FTIR, and 3 MS (GC)

3,5-Dimethyl-1-hexyn-3-ol
SpectraBase Compound ID 56UuPXC8UVo
InChI InChI=1S/C8H14O/c1-5-8(4,9)6-7(2)3/h1,7,9H,6H2,2-4H3
InChIKey NECRQCBKTGZNMH-UHFFFAOYSA-N
Mol Weight 126.2 g/mol
Molecular Formula C8H14O
Exact Mass 126.104465 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID K2yUiDp2SSh
Name 3,5-Dimethyl-1-hexyn-3-ol
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 278394
CAS Registry Number 107-54-0
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H14O
InChI InChI=1S/C8H14O/c1-5-8(4,9)6-7(2)3/h1,7,9H,6H2,2-4H3
InChIKey NECRQCBKTGZNMH-UHFFFAOYSA-N
Observed nucleus 13C
Purity 98%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_13CNMR_005145